"Learn how to set up and analyze an RC circuit using the PhET Simulator! In this tutorial, I’ll guide you through the step-by-step process of building a simple resistor-capacitor circuit, explaining ...

Abstract: Since they offer profound insights into the atomic-level interactions between drug candidates and their biological targets, molecular dynamics (MD) simulations have become extremely ...

Intrinsically Disordered Proteins (IDPs) challenge traditional structure-function paradigms by existing as dynamic ensembles rather than stable tertiary structures. Capturing these ensembles is ...

The materials have been made available under an MIT license. The materials are as-is with no liability for the author. Please provide credit if you reuse the code in ...

A new technical paper titled “Modeling and Simulating Emerging Memory Technologies: A Tutorial” was published by researchers at TU Dortmund, TU Dresden, Karlsruhe Institute of Technology (KIT) and FAU ...

Molecular dynamics (MD) is a popular method for studying molecular systems and microscopic processes at the atomic level. However, MD simulations can be quite computationally expensive due to the ...

Creative Commons (CC): This is a Creative Commons license. Attribution (BY): Credit must be given to the creator. Atomistic molecular dynamics (MD) simulations have become an indispensable tool for ...

The study presents a valuable tool for searching molecular dynamics simulation data, making such datasets accessible for open science. The authors provide convincing evidence that it is possible to ...

In order to estimate the effective storage capacity of carbon dioxide in geological storage, it makes great significance to understand the seepage mechanism of flowing carbon dioxide fluid and its ...